2-[3-[2-(1H-imidazol-5-yl)ethyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(4-methylphenyl)ethanamide

Systemtic Name: 2-[3-[2-(1H-imidazol-5-yl)ethyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(4-methylphenyl)ethanamide Openeye Name: 2-[3-[2-(1H-imidazol-5-yl)ethyl]-4-oxo-quinazolin-2-yl]sulfanyl-N-(p-tolyl)acetamide CAS Name: 2-[[3-[2-(1H-imidazol-5-yl)ethyl]-4-oxo-2-quinazolinyl]thio]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[3-[2-(1H-imidazol-5-yl)ethyl]-4-oxoquinazolin-2-yl]sulfanyl-N-(4-methylphenyl)acetamide Traditional Name: 2-[[3-[2-(1H-imidazol-5-yl)ethyl]-4-keto-quinazolin-2-yl]thio]-N-(p-tolyl)acetamide Formula: C22H21N5O2S MolecularWeight: 419.49944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCC4=CN=CN4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCC4=CN=CN4

InChI

InChI=1S/C22H21N5O2S/c1-15-6-8-16(9-7-15)25-20(28)13-30-22-26-19-5-3-2-4-18(19)21(29)27(22)11-10-17-12-23-14-24-17/h2-9,12,14H,10-11,13H2,1H3,(H,23,24)(H,25,28)